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{4-[5-(4-fluorophenyl)-2-methansulfinyl-3-(2-methoxyethyl)-3H-imidazol-4-yl]pyridine-2-yl}(l-phenylethyl)amine
SpectraBase Compound ID L1UeDD7Q2oL
InChI InChI=1S/C26H27FN4O2S/c1-18(19-7-5-4-6-8-19)29-23-17-21(13-14-28-23)25-24(20-9-11-22(27)12-10-20)30-26(34(3)32)31(25)15-16-33-2/h4-14,17-18H,15-16H2,1-3H3,(H,28,29)
InChIKey WSQMKYARMKGNSR-UHFFFAOYSA-N
Mol Weight 478.59 g/mol
Molecular Formula C26H27FN4O2S
Exact Mass 478.183875 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7335H3cyi7Y
Name {4-[5-(4-fluorophenyl)-2-methansulfinyl-3-(2-methoxyethyl)-3H-imidazol-4-yl]pyridine-2-yl}(l-phenylethyl)amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27FN4O2S
InChI InChI=1S/C26H27FN4O2S/c1-18(19-7-5-4-6-8-19)29-23-17-21(13-14-28-23)25-24(20-9-11-22(27)12-10-20)30-26(34(3)32)31(25)15-16-33-2/h4-14,17-18H,15-16H2,1-3H3,(H,28,29)
InChIKey WSQMKYARMKGNSR-UHFFFAOYSA-N
Instrument Name Agilent GC 6890 plus + MSD 5973
Ionization Type EI
Molecular Weight 478.586 g/mol
SMILES N(c1nccc(-c2[n](CCOC)c(S(=O)C)nc2-c2ccc(F)cc2)c1)C(c1ccccc1)C
SPLASH splash10-03di-0200900000-f1ed0f5f3202fca53a82
Source of Spectrum BRPI0608739A2
Wiley ID 1861457